File name: Pandora21s1_Bremen_20210903_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T085425.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210903_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20210903 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20210903T072937.7Z 7916.312242 291 1 50.21 2 65.58 111.60 30.79 153.40 0.00 1 0.00 1 0 25 5.343e-02 1.076e-02 4.187e-02 7.232e-03 3.030833e-01 3.787754e-03 4.023598e-03 -6.000000e+00 3.210986e-02 230.23 -2.00 3.88 -2.00 318.61 0.00e+00 -5.621913e-04 6.877007e-04 1.020025e-04 -6.000000e+00 1.280164e-03 280.86 -2.00 20.00 -2.00 318.28 0.00e+00 2.402 0.000 302.00 328.00 3 5.8054e+00 1.0226e-02 2.9696e-02 -6.0000e+00 8.0788e-02 5.6552e-02 1.1480e-02 1.7550e-02 -6.0000e+00 8.7655e-02 1.8433e-02 7.8035e-03 8.7261e-03 -6.0000e+00 5.1431e-02 -1.1111e-02 4.0535e-03 2.5193e-03 -6.0000e+00 2.1219e-02 9.9197e-05 -7.6813e-04 2.3315e-04 3.1708e-05 -6.0000e+00 1.6057e-03 -1.4383e-03 -3.2886e-05 12 8 8 10 0 0 99.97 22.20 0.30 -0.00144 -0.00721 53 10 1 5 0 947.314 25.28 20.00 22.20 23.40 27.0 1019.06 -13748 29812 9840 6350 -13175 11559 -12161 11316 4127 2775 10783 -2340 29279 -10064 7986 -10801 3164 -9791 4911 -4267 -9092 4198 366 5864 -5787 4831 -5009 1988 -2230 -2686 3962 3676 9119 -3272 3237 -6767 1448 1212 1505 -1561 -3721 2957 -3732 1128 -6880 2144 -1928 2232 -914 -1029 1194 286 1231 -695 445 -2858 4086 -107 1833 519 883 1535 1972 846 398 2187 793 2927 -355 3002 -421 403 565 -439 1698 -40 1466 -2261 716 -1431 -913 -2739 -1826 -1166 -2471 -560 -1156 2171 -711 626 -234 1405 778 900 618 -10 662 -143 155 -165 463 -1147 -842 -529 -1274 -487 -943 163 -231 768 491 800 -618 -371 -98 -373 994 -773 398 -1546 341 -38 18 -159 1060 393 -939 2116 -262 1064 260 431 -169 590 243 48 457 253 532 -777 -393 -1106 -226 -860 1397 560 358 -821 567 -770 648 277 199 734 -186 1949 -1078 823 -1448 396 -1445 661 -647 -1477 609 56 908 -1060 834 -948 339 -377 -451 658 664 1687 -701 636 -1445 307 298 437 -541 -1452 1145 -1589 465 -3069 877 -812 888 -372 -425 507 131 596 -361 238 -1621 2214 -61 1004 286 497 914 1263 582 279 1437 497 1757 -231 2102 -332 332 468 -356 1271 -28 919 -1399 444 -1000 -711 -2395 -1702 -1141 -2597 -615 -1349 2540 -859 727 -258 1410 728 813 581 -11 749 -179 207 -222 592 -1384 -959 -604 -1553 -625 -1272 227 -340 1188 803 1338 -1030 -586 -144 -518 1336 -1084 583 -2439 545 -61 28 -240 1521 542 -1258 2725 -361 1546 403 689 -279 1000 432 89 881 498 1055 -1542 -754 -2059 -407 SS 20210903T074320.1Z 7916.321760 299 1 49.94 2 63.69 114.72 29.99 159.21 0.00 1 0.00 1 0 25 1.601e-02 5.572e-03 1.515e-02 3.128e-03 2.829012e-01 1.636872e-03 3.758611e-03 -6.000000e+00 9.627920e-03 230.23 -2.00 3.88 -2.00 318.29 0.00e+00 2.115309e-04 2.733123e-04 8.840429e-05 -6.000000e+00 3.836139e-04 280.85 -2.00 20.00 -2.00 317.96 0.00e+00 2.243 0.000 302.00 328.00 3 4.9464e+00 4.3928e-03 2.7719e-02 -6.0000e+00 2.4225e-02 4.4834e-02 4.9160e-03 1.6360e-02 -6.0000e+00 2.6279e-02 1.0218e-02 3.2262e-03 8.1129e-03 -6.0000e+00 1.5419e-02 -1.0186e-02 1.6535e-03 2.3316e-03 -6.0000e+00 6.3651e-03 2.8413e-04 -4.9219e-05 1.0038e-04 2.9089e-05 -6.0000e+00 4.8110e-04 -2.4287e-03 8.2549e-05 10 0 0 10 0 0 99.98 22.20 0.12 -0.00243 -0.00280 78 15 1 5 0 640.157 25.28 20.00 22.20 23.99 27.0 1022.57 -1418 1977 -10546 522 -1645 3030 6105 4438 541 54 -5087 -2443 430 -3811 2797 -1370 661 -1835 -1959 207 1229 896 320 3340 -1002 209 1778 304 -514 3096 -14 -1299 2470 -2017 458 -402 -18 1068 135 -1843 -1391 -1292 -1621 -1269 -1871 -9 -1000 -411 -48 638 209 691 1259 181 1339 588 1277 540 944 784 1196 1366 781 149 -769 1197 -1084 1990 147 1335 -240 -308 -402 -307 501 -171 660 -270 762 -770 21 -971 -1632 -1161 -871 -319 -1016 342 -97 206 -25 769 602 880 453 471 1028 260 74 -408 -268 -663 -185 -39 -992 -334 -582 -70 30 514 -70 282 -32 -207 501 119 562 432 -67 -614 -740 -369 -413 187 212 217 853 1026 499 542 216 -114 -68 179 85 -211 309 -28 -163 -375 156 -403 -99 -94 139 -851 36 -109 186 381 311 43 5 -458 -224 42 -446 349 -195 98 -291 -324 35 209 154 57 604 -199 43 357 59 -97 555 -3 -276 545 -478 103 -90 -4 292 44 -708 -585 -573 -744 -589 -876 -4 -459 -184 -21 284 97 342 658 101 762 346 759 324 557 462 719 872 540 110 -577 840 -731 1272 100 994 -197 -266 -350 -260 397 -125 438 -172 495 -557 17 -862 -1561 -1164 -922 -357 -1205 413 -119 245 -29 796 579 815 436 490 1172 326 98 -549 -346 -801 -212 -45 -1218 -431 -786 -98 44 791 -113 467 -52 -321 723 163 753 594 -97 -948 -1177 -585 -642 280 305 300 1124 1336 680 785 331 -181 -111 297 148 -385 578 -54 -314 -720 289 -730 -174 SS 20210903T074803.0Z 7916.325034 302 1 49.94 2 63.05 115.82 29.77 161.26 0.00 1 0.00 1 0 25 2.501e-02 6.423e-03 1.510e-02 3.273e-03 2.771794e-01 1.711920e-03 3.688506e-03 -6.000000e+00 1.503150e-02 230.22 -2.00 3.88 -2.00 318.18 0.00e+00 -1.241349e-05 2.774172e-04 8.338289e-05 -6.000000e+00 5.992058e-04 280.85 -2.00 20.00 -2.00 317.85 0.00e+00 2.194 0.000 302.00 328.00 3 5.1688e+00 4.5847e-03 2.7127e-02 -6.0000e+00 3.7819e-02 4.6680e-02 5.1271e-03 1.6023e-02 -6.0000e+00 4.1032e-02 7.3831e-03 3.3272e-03 7.9415e-03 -6.0000e+00 2.4076e-02 -8.1803e-03 1.6972e-03 2.2777e-03 -6.0000e+00 9.9341e-03 2.4075e-04 -5.8307e-04 1.0479e-04 2.8486e-05 -6.0000e+00 7.5154e-04 -1.2296e-03 1.0048e-05 11 8 0 10 0 0 99.96 22.21 0.22 -0.00123 -0.00561 52 10 1 5 0 960.141 25.28 20.00 22.21 24.29 27.1 1024.46 1548 -9450 -4 9099 -4040 10088 -6716 10522 -3662 7766 -9459 6408 -3654 -530 -1613 -51 -535 -2639 2169 -3836 4788 -480 4033 -2468 -1035 2092 -1948 2011 32 548 -2611 790 1916 -993 -2110 832 -1319 275 1549 -2809 -87 -2392 151 -1998 -1055 -676 -1076 -220 -1266 2040 -619 1861 504 707 469 1268 761 366 1612 443 2468 644 1443 99 679 -7 156 1028 274 1395 -508 599 -735 274 -720 284 517 255 740 -618 158 -1860 -961 -1739 -474 -1365 -128 -642 -302 487 -165 928 149 1561 112 615 1109 536 -111 -765 45 -845 20 -364 -512 -827 -306 -157 82 514 20 185 -79 220 -62 578 -358 731 -265 -622 -305 -500 334 4 517 76 653 924 347 185 1 251 -141 589 -218 224 6 136 16 -130 -313 -774 50 107 -786 0 624 -289 613 -500 741 -324 651 -945 574 -397 -64 -222 -8 -85 -445 364 -705 830 -88 724 -496 -217 442 -427 407 6 105 -541 171 442 -242 -505 191 -332 79 518 -1131 -37 -1112 71 -967 -507 -323 -511 -101 -584 921 -299 936 272 401 276 759 466 225 969 268 1502 423 1012 74 512 -5 106 675 190 1054 -425 521 -651 234 -586 210 350 164 488 -452 128 -1681 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